{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3842448 -0.4285465 -1.6736838 ] [ -0.1826748 -0.1467795 0.4671551 ] [ -0.0832058 -0.4306892 -0.77648 ] [ -1.2518773 -1.014033 3.9700613 ] [ 1.5602222 0.9161468 -2.1195241 ] [ -0.7671296 0.535857 2.2116504 ] [ 0.4082669 -0.1627134 -2.5577809 ] [ -0.0678463 0.7307578 0.478602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.156280402960031e-10 -6.866071888824809e-10 -2.681537077064329e-09 ] [ -2.926772961806231e-10 -2.35166685250203e-10 7.484649856739333e-10 ] [ -1.333103885732772e-10 -6.900401727561527e-10 -1.24405811276832e-09 ] [ -2.005728558695008e-09 -1.624659978704922e-09 6.360739450407663e-09 ] [ 2.499751552688075e-09 1.467828996273871e-09 -3.395851988219879e-09 ] [ -1.229077120369766e-09 8.58537564565338e-10 3.543454593456753e-09 ] [ 6.541156876156145e-10 -2.606956075186956e-10 -4.098016792871491e-09 ] [ -1.087017565633542e-10 1.170803072273245e-09 7.668049413856679e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.652468 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.71215511740327e-18 } }